Detailed information for compound 159421

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 466.571 | Formula: C30H30N2O3
  • H donors: 1 H acceptors: 2 LogP: 6.85 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=c1cc(C)c2c(o1)cc(cc2)CCc1n[nH]c2c1c(ccc2)OCc1ccc(cc1)C(C)(C)C
  • InChi: 1S/C30H30N2O3/c1-19-16-28(33)35-27-17-20(10-14-23(19)27)11-15-25-29-24(31-32-25)6-5-7-26(29)34-18-21-8-12-22(13-9-21)30(2,3)4/h5-10,12-14,16-17H,11,15,18H2,1-4H3,(H,31,32)
  • InChiKey: SYCOIFMQNYRBFC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli DNA gyrase (type II topoisomerase), subunit A Starlite/ChEMBL References
Escherichia coli DNA gyrase, subunit B References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania mexicana mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Neospora caninum DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium berghei DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium berghei DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium vivax DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium ulcerans DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium knowlesi DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Treponema pallidum DNA gyrase, subunit B (gyrB) Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium leprae Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) Get druggable targets OG5_128755 All targets in OG5_128755
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania major mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Theileria parva DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium falciparum DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Theileria parva DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) Get druggable targets OG5_129568 All targets in OG5_129568
Trypanosoma brucei gambiense DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein Get druggable targets OG5_128755 All targets in OG5_128755
Babesia bovis DNA gyrase A subunit, putative Get druggable targets OG5_129568 All targets in OG5_129568
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Chlamydia trachomatis DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Neospora caninum hypothetical protein Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania braziliensis mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Babesia bovis DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania donovani mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium knowlesi DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Trypanosoma congolense DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium vivax DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Leishmania infantum mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium yoelii DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium yoelii DNA gyrase subunit a-related Get druggable targets OG5_129568 All targets in OG5_129568
Trypanosoma brucei DNA topoisomerase ii Get druggable targets OG5_128755 All targets in OG5_128755
Treponema pallidum DNA gyrase, subunit A (gyrA) Get druggable targets OG5_129568 All targets in OG5_129568
Chlamydia trachomatis DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium falciparum DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Mycobacterium ulcerans DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) Get druggable targets OG5_129568 All targets in OG5_129568
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0044 0.1043
Treponema pallidum alginate O-acetylation protein (algI) 0.0165 0.0163 0.0763
Echinococcus granulosus chromobox protein 1 0.0067 0.0038 0.0013
Brugia malayi Hhat protein 0.0165 0.0163 0.0163
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0058 0.0026 0.0005
Onchocerca volvulus 0.1808 0.2263 1
Onchocerca volvulus 0.0165 0.0163 0.0722
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0165 0.0163 0.0139
Toxoplasma gondii mono- or diacylglycerol acyltransferase 0.04 0.0464 0.1962
Trypanosoma brucei hypothetical protein, conserved 0.0072 0.0044 0.0088
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0984 0.1211 0.5298
Giardia lamblia DNA topoisomerase II 0.0064 0.0034 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0072 0.0044 0.038
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0004 0.0016
Trichomonas vaginalis chromobox protein, putative 0.0067 0.0038 0.0893
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0153 0.0147 0.237
Echinococcus granulosus o acyltransferase membrane bound domain 0.0165 0.0163 0.0139
Mycobacterium ulcerans beta-lactamase 0.0072 0.0044 0.0448
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Brugia malayi MBOAT family protein 0.0165 0.0163 0.0163
Echinococcus granulosus o acyltransferase membrane bound domain 0.0165 0.0163 0.0139
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0184 0.0187 0.0187
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0165 0.0163 0.0139
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Treponema pallidum DNA gyrase, subunit A (gyrA) 0.0318 0.0358 1
Leishmania major diacylglycerol acyltransferase, putative 0.1808 0.2263 1
Leishmania major glycerol uptake protein, putative 0.0165 0.0163 0.062
Loa Loa (eye worm) hypothetical protein 0.7858 1 1
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0165 0.0163 0.0139
Trypanosoma cruzi GUP1, putative 0.0165 0.0163 0.062
Loa Loa (eye worm) hypothetical protein 0.0819 0.0999 0.0999
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0044 0.002
Trypanosoma brucei glycerol uptake protein, putative 0.0165 0.0163 0.062
Loa Loa (eye worm) heterochromatin protein 1 0.0067 0.0038 0.0038
Mycobacterium leprae conserved hypothetical protein 0.0072 0.0044 0.1987
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0184 0.0187 0.0163
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Echinococcus granulosus sterol O acyltransferase 1 0.0165 0.0163 0.0139
Loa Loa (eye worm) hhat protein 0.0165 0.0163 0.0163
Trypanosoma cruzi GUP1, putative 0.0165 0.0163 0.062
Trichomonas vaginalis conserved hypothetical protein 0.0165 0.0163 0.3857
Trichomonas vaginalis transmembrane protein nessy, putative 0.0165 0.0163 0.3857
Brugia malayi MBOAT family protein 0.0165 0.0163 0.0163
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0165 0.0163 0.0139
Mycobacterium leprae Probable lipase LipE 0.0072 0.0044 0.1987
Loa Loa (eye worm) MBOAT family protein 0.0165 0.0163 0.0163
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0015 0.0015
Onchocerca volvulus 0.0236 0.0253 0.1118
Mycobacterium tuberculosis Probable lipase LipE 0.0072 0.0044 0.038
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0072 0.0044 0.038
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0165 0.0163 0.0139
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0072 0.0044 0.0044
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0318 0.0358 0.6445
Plasmodium vivax DNA gyrase subunit A, putative 0.0318 0.0358 0.2813
Loa Loa (eye worm) hypothetical protein 0.0165 0.0163 0.0163
Mycobacterium ulcerans esterase/lipase LipP 0.0072 0.0044 0.0448
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0984 0.1211 0.1189
Trichomonas vaginalis esterase, putative 0.0072 0.0044 0.1043
Onchocerca volvulus 0.0072 0.0044 0.0195
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0165 0.0163 0.0139
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0165 0.0163 0.0139
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Leishmania major DNA topoisomerase ii 0.0058 0.0026 0.0005
Trypanosoma cruzi DNA topoisomerase II, putative 0.0058 0.0026 0.0005
Schistosoma mansoni zinc finger protein 0.0165 0.0163 0.0139
Brugia malayi diacylglycerol acyltransferase 0.0984 0.1211 0.1211
Schistosoma mansoni DNA topoisomerase II 0.0069 0.004 0.0015
Schistosoma mansoni chromobox protein 0.0067 0.0038 0.0013
Loa Loa (eye worm) hypothetical protein 0.005 0.0015 0.0015
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Loa Loa (eye worm) diacylglycerol acyltransferase 0.1808 0.2263 0.2263
Brugia malayi Glycosylation related protein 12, isoform 0.0164 0.0162 0.0162
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A 0.0318 0.0358 1
Leishmania major hypothetical protein, unknown function,protein, unknown function 0.04 0.0464 0.1962
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.7858 1 1
Loa Loa (eye worm) beta-lactamase 0.0072 0.0044 0.0044
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0044 0.0088
Leishmania major hypothetical protein, conserved 0.0072 0.0044 0.0088
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0165 0.0163 1
Trypanosoma cruzi DNA topoisomerase II, putative 0.0058 0.0026 0.0005
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0165 0.0163 0.0139
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0044 0.1043
Schistosoma mansoni chromobox protein 0.0067 0.0038 0.0013
Leishmania major glycerol uptake protein, putative 0.0165 0.0163 0.062
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Mycobacterium tuberculosis Probable esterase LipL 0.0072 0.0044 0.038
Loa Loa (eye worm) hypothetical protein 0.0165 0.0163 0.0163
Echinococcus multilocularis chromobox protein 1 0.0067 0.0038 0.0013
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.1808 0.2263 1
Brugia malayi beta-lactamase 0.0072 0.0044 0.0044
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0044 0.002
Entamoeba histolytica hypothetical protein 0.0165 0.0163 1
Trichomonas vaginalis porcupine, putative 0.0165 0.0163 0.3857
Onchocerca volvulus 0.0072 0.0044 0.0195
Leishmania major hypothetical protein, conserved 0.0165 0.0163 0.062
Trypanosoma brucei DNA topoisomerase ii 0.0121 0.0107 0.0368
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0072 0.0044 0.0044
Echinococcus multilocularis beta LACTamase domain containing family member 0.0072 0.0044 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0225 0.0239 0.5653
Brugia malayi GNT-I family protein 0.0485 0.0572 0.0572
Leishmania major glycerol uptake protein, putative 0.0165 0.0163 0.062
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0165 0.0163 0.0139
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0165 0.0163 0.0163
Plasmodium vivax DNA gyrase subunit B, putative 0.0153 0.0147 0.1035
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0165 0.0163 0.0139
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.0153 0.0147 0.3678
Mycobacterium ulcerans DNA gyrase subunit A 0.0318 0.0358 0.7596
Schistosoma mansoni hypothetical protein 0.04 0.0464 0.044
Leishmania major diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.1808 0.2263 1
Trichomonas vaginalis conserved hypothetical protein 0.0165 0.0163 0.3857
Loa Loa (eye worm) pax transcription factor protein 2 0.0236 0.0253 0.0253
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0069 0.004 0.004
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0184 0.0187 0.0163
Trypanosoma brucei glycerol uptake protein, putative 0.0165 0.0163 0.062
Toxoplasma gondii diacylglycerol acyltransferase 0.04 0.0464 0.1962
Loa Loa (eye worm) hypothetical protein 0.0485 0.0572 0.0572
Toxoplasma gondii hypothetical protein 0.0165 0.0163 0.062
Entamoeba histolytica vacuolar protein sorting 26 0.0165 0.0163 1
Schistosoma mansoni hypothetical protein 0.0165 0.0163 0.0139
Trypanosoma cruzi glycerol uptake protein, putative 0.0165 0.0163 0.062
Brugia malayi Heterochromatin protein 1 0.0067 0.0038 0.0038
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0057 0.0025 0.0025
Plasmodium falciparum DNA gyrase subunit B 0.0153 0.0147 0.1035
Chlamydia trachomatis DNA gyrase subunit A 0.0318 0.0358 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0072 0.0044 0.002
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0121 0.0107 0.0368
Onchocerca volvulus 0.0072 0.0044 0.0195
Loa Loa (eye worm) TOPoisomerase family member 0.0069 0.004 0.004
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.7858 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.1808 0.2263 1
Plasmodium vivax hypothetical protein, conserved 0.0072 0.0044 0.0166
Brugia malayi MBOAT family protein 0.0165 0.0163 0.0163
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0044 0.1043
Trypanosoma cruzi glycerol uptake protein, putative 0.0165 0.0163 0.062
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0165 0.0163 0.0139
Loa Loa (eye worm) hypothetical protein 0.0165 0.0163 0.0163
Brugia malayi MBOAT family protein 0.0165 0.0163 0.0163
Brugia malayi diacylglycerol acyltransferase family protein 0.1808 0.2263 0.2263
Trichomonas vaginalis chromobox protein, putative 0.0067 0.0038 0.0893
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Echinococcus granulosus chromobox protein 1 0.0067 0.0038 0.0013
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.7858 1 1
Plasmodium vivax DNA topoisomerase II, putative 0.0069 0.004 0.0127
Trichomonas vaginalis DNA topoisomerase II, putative 0.0069 0.004 0.0936
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0165 0.0163 0.0139
Mycobacterium ulcerans hypothetical protein 0.04 0.0464 1
Toxoplasma gondii dgat2l1-prov protein 0.1808 0.2263 1
Leishmania major mitochondrial DNA topoisomerase II 0.0121 0.0107 0.0368
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0072 0.0044 0.0448
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0165 0.0163 0.0139
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Schistosoma mansoni alpha-13-mannosyl-glycoprotein beta-1 2-n-acetylglucosaminyltransferase 0.0485 0.0572 0.0548
Trypanosoma cruzi glycerol uptake protein, putative 0.0165 0.0163 0.062
Plasmodium falciparum DNA gyrase subunit A 0.0318 0.0358 0.2813
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0069 0.004 0.004
Trichomonas vaginalis conserved hypothetical protein 0.0165 0.0163 0.3857
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0984 0.1211 1
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0984 0.1211 1
Echinococcus granulosus o acyltransferase membrane bound domain 0.0165 0.0163 0.0139
Loa Loa (eye worm) hhat protein 0.0165 0.0163 0.0163
Brugia malayi methionyl-tRNA synthetase 0.0057 0.0025 0.0025
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0044 0.1043
Plasmodium falciparum DNA topoisomerase 2 0.0069 0.004 0.0127
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.0187 0.0163
Mycobacterium tuberculosis Conserved protein 0.0072 0.0044 0.038
Brugia malayi beta-lactamase family protein 0.0072 0.0044 0.0044
Schistosoma mansoni sterol O-acyltransferase 1 0.0165 0.0163 0.0139
Loa Loa (eye worm) MBOAT family protein 0.0165 0.0163 0.0163
Loa Loa (eye worm) hypothetical protein 0.0485 0.0572 0.0572
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0069 0.004 0.0015
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0004 0.0087
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0184 0.0187 0.0187
Leishmania major diacylglycerol acyltransferase, putative 0.04 0.0464 0.1962
Toxoplasma gondii Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase 0.0164 0.0162 0.0614
Echinococcus granulosus alpha 13 mannosyl glycoprotein 0.0485 0.0572 0.0548
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0184 0.0187 0.0163
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0015 0.0015
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0184 0.0187 0.0163
Echinococcus multilocularis alpha 1,3 mannosyl glycoprotein 0.0485 0.0572 0.0548
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0165 0.0163 1
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0121 0.0107 0.0368
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0069 0.004 0.0015
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0004 0.0087
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0057 0.0025 0.0579
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.0187 0.0163
Toxoplasma gondii ABC1 family protein 0.0072 0.0044 0.0088
Toxoplasma gondii DNA topoisomerase 2, putative 0.0069 0.004 0.0068
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0984 0.1211 0.1189
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0152 0.0145 1
Brugia malayi Pax transcription factor protein 2 0.0236 0.0253 0.0253
Mycobacterium tuberculosis Conserved protein 0.0072 0.0044 0.038
Leishmania major glycerol uptake protein, putative 0.0165 0.0163 0.062
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0015 0.0015
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Mycobacterium tuberculosis Probable hydrolase 0.0072 0.0044 0.038
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0165 0.0163 0.0139
Mycobacterium ulcerans hypothetical protein 0.0072 0.0044 0.0448
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0069 0.004 0.0175
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0165 0.0163 1
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0058 0.0026 0.0005
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0088 0.0065 0.018
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0984 0.1211 0.1211
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0044 0.1043
Brugia malayi beta-lactamase family protein 0.0072 0.0044 0.0044
Brugia malayi Probable DNA topoisomerase II 0.0069 0.004 0.004
Mycobacterium ulcerans lipase LipD 0.0072 0.0044 0.0448
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0184 0.0187 0.0163
Leishmania major glycerol uptake protein, putative 0.0165 0.0163 0.062
Mycobacterium tuberculosis Probable lipase LipD 0.0072 0.0044 0.038
Schistosoma mansoni diacylglycerol O-acyltransferase 0.04 0.0464 0.044
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0069 0.004 0.0175
Echinococcus multilocularis chromobox protein 1 0.0067 0.0038 0.0013
Mycobacterium ulcerans DNA gyrase subunit B 0.0153 0.0147 0.2793
Mycobacterium leprae Probable methionyl-tRNA synthase MetS 0.0057 0.0025 0.0433
Brugia malayi MBOAT family protein 0.0165 0.0163 0.0163
Echinococcus multilocularis sterol O acyltransferase 1 0.0165 0.0163 0.0139
Loa Loa (eye worm) hypothetical protein 0.0165 0.0163 0.0163
Chlamydia trachomatis DNA gyrase subunit B 0.0153 0.0147 0.2419
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0984 0.1211 0.1189
Schistosoma mansoni diacylglycerol O-acyltransferase 0.04 0.0464 0.044
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0069 0.004 0.0175
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0044 0.0088
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0462 0.0542 1
Loa Loa (eye worm) hypothetical protein 0.0164 0.0162 0.0162
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0044 0.0044
Mycobacterium tuberculosis Conserved protein 0.0072 0.0044 0.038
Entamoeba histolytica hypothetical protein, conserved 0.0165 0.0163 1
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0984 0.1211 0.5298
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.1808 0.2263 0.2244
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0165 0.0163 0.0139
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein 0.0318 0.0358 0.1491
Loa Loa (eye worm) MBOAT family protein 0.0165 0.0163 0.0163
Toxoplasma gondii hypothetical protein 0.0144 0.0136 0.0497
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.0423 1
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0165 0.0163 0.0139
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0072 0.0044 0.038

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.25 ug ml-1 Inhibitory activity against E. coli DNA gyrase ChEMBL. 15125947
IC50 (binding) = 0.25 ug ml-1 Inhibitory activity against E. coli DNA gyrase ChEMBL. 15125947
IC50 (binding) > 128 ug ml-1 Inhibitory activity against E. coli DNA topoisomerase IV ChEMBL. 15125947
IC50 (binding) > 400 ug ml-1 Inhibitory activity against human DNA topoisomerase II ChEMBL. 15125947
IC50 (binding) > 400 ug ml-1 Inhibitory activity against human DNA topoisomerase II ChEMBL. 15125947
MIC (functional) > 128 ug ml-1 Inhibitory activity against Staphylococcus aureus FDA 209P ChEMBL. 15125947
MIC (functional) > 128 ug ml-1 Inhibitory activity against Staphylococcus aureus KMP9 ChEMBL. 15125947
MIC (functional) > 128 ug ml-1 Inhibitory activity against Enterococcus faecalis ATCC 29212 ChEMBL. 15125947
MIC (functional) > 128 ug ml-1 Inhibitory activity against Enterococcus faecalis KU 1777 ChEMBL. 15125947

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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